N-[5-(2-oxo-2-{2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl}ethyl)-1,3,4-thiadiazol-2-yl]-N'-phenylurea
Chemical Structure Depiction of
N-[5-(2-oxo-2-{2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl}ethyl)-1,3,4-thiadiazol-2-yl]-N'-phenylurea
N-[5-(2-oxo-2-{2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl}ethyl)-1,3,4-thiadiazol-2-yl]-N'-phenylurea
Compound characteristics
| Compound ID: | 1067-0559 |
| Compound Name: | N-[5-(2-oxo-2-{2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl}ethyl)-1,3,4-thiadiazol-2-yl]-N'-phenylurea |
| Molecular Weight: | 470.51 |
| Molecular Formula: | C21 H22 N6 O5 S |
| Smiles: | COc1cc(/C=N/NC(Cc2nnc(NC(Nc3ccccc3)=O)s2)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1001 |
| logD: | 3.0977 |
| logSw: | -3.5258 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.662 |
| InChI Key: | MFVXGPBIPWSZNE-UHFFFAOYSA-N |